4-bromanyl-2-[[4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]phenol

Systemtic Name: 4-bromanyl-2-[[4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]phenol Openeye Name: 4-bromo-2-[[4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]phenol CAS Name: 4-bromo-2-[[4-[(3-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]methyl]phenol IUPAC Name: 4-bromo-2-[[4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]phenol Traditional Name: 4-bromo-2-[(4-m-anisylpiperazine-1,4-diium-1-yl)methyl]phenol Formula: C19H25BrN2O2+2 MolecularWeight: 393.318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CC[NH+](CC2)CC3=C(C=CC(=C3)Br)O

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CC[NH+](CC2)CC3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C19H23BrN2O2/c1-24-18-4-2-3-15(11-18)13-21-7-9-22(10-8-21)14-16-12-17(20)5-6-19(16)23/h2-6,11-12,23H,7-10,13-14H2,1H3/p+2